| CAS Number | 909532-39-4 |
| Catalog Number | AG00IGDA(AGN-PC-0WANQ8) |
| Chemical Name | 2-Bromo-α,α-dimethyl-3-pyridinemethanol |
| IUPAC Name | 2-(2-bromopyridin-3-yl)propan-2-ol |
| InChI | InChI=1S/C8H10BrNO/c1-8(2,11)6-4-3-5-10-7(6)9/h3-5,11H,1-2H3 |
| InChI Key | CXLQQPDHVZWLHV-UHFFFAOYSA-N |
| MDL Number | MFCD16988535 |
| Molecular Formula | C8H10BrNO |
| Molecular Weight | 216.0751 |
| SMILES | BrC1=NC=CC=C1C(O)(C)C |
| Synonyms | 909532-39-4,
2-(2-bromopyridin-3-yl)propan-2-ol,
2-(2-Bromo-pyridin-3-yl)-propan-2-ol,
SCHEMBL1804567,
CXLQQPDHVZWLHV-UHFFFAOYSA-N,
MFCD16988535,
ZINC97758929,
2-(2-Bromo-3-pyridyl)propan-2-ol,
AKOS025287506,
AM85259,
KS-000011L5,
AS-55160,
DA-01381,
FT-0737518,
3-Pyridinemethanol, 2-bromo-alpha,alpha-dimethyl-,
ACN-046625,
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| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.995g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 216.078g/mol |
| Monoisotopic Mass | 214.995g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 33.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number